bis([diphenyl-[4-(trifluoromethyl)phenyl]silyl]azanide);bis(N-[2,6-di(propan-2-yl)phenyl]-1-[6-[N-[2,6-di(propan-2-yl)phenyl]-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine);bis(iridium)

C104H116F6Ir2N8Si2-2 — CID 139121912

About bis([diphenyl-[4-(trifluoromethyl)phenyl]silyl]azanide);bis(N-[2,6-di(propan-2-yl)phenyl]-1-[6-[N-[2,6-di(propan-2-yl)phenyl]-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine);bis(iridium)

bis([diphenyl-[4-(trifluoromethyl)phenyl]silyl]azanide);bis(N-[2,6-di(propan-2-yl)phenyl]-1-[6-[N-[2,6-di(propan-2-yl)phenyl]-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine);bis(iridium) (PubChem CID 139121912) has the molecular formula C104H116F6Ir2N8Si2-2 and a molecular weight of 2032.72 g/mol. Its IUPAC name is bis([diphenyl-[4-(trifluoromethyl)phenyl]silyl]azanide);bis(N-[2,6-di(propan-2-yl)phenyl]-1-[6-[N-[2,6-di(propan-2-yl)phenyl]-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine);bis(iridium).

Molecular Properties

• Compound Name: bis([diphenyl-[4-(trifluoromethyl)phenyl]silyl]azanide);bis(N-[2,6-di(propan-2-yl)phenyl]-1-[6-[N-[2,6-di(propan-2-yl)phenyl]-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine);bis(iridium)
• PubChem CID: 139121912
• Molecular Formula: C104H116F6Ir2N8Si2-2
• Molecular Weight: 2032.72 g/mol
• Exact Mass: 2032.80
• IUPAC Name: bis([diphenyl-[4-(trifluoromethyl)phenyl]silyl]azanide);bis(N-[2,6-di(propan-2-yl)phenyl]-1-[6-[N-[2,6-di(propan-2-yl)phenyl]-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine);bis(iridium)
• SMILES: C/C(=N\c1c(C(C)C)cccc1C(C)C)c1cccc(/C(C)=N/c2c(C(C)C)cccc2C(C)C)n1.C/C(=N\c1c(C(C)C)cccc1C(C)C)c1cccc(/C(C)=N/c2c(C(C)C)cccc2C(C)C)n1.[Ir].[Ir].[NH-][Si](c1ccccc1)(c1ccccc1)c1ccc(C(F)(F)F)cc1.[NH-][Si](c1ccccc1)(c1ccccc1)c1ccc(C(F)(F)F)cc1
• InChI: InChI=1S/2C33H43N3.2C19H15F3NSi.2Ir/c2*1-20(2)26-14-11-15-27(21(3)4)32(26)34-24(9)30-18-13-19-31(36-30)25(10)35-33-28(22(5)6)16-12-17-29(33)23(7)8;2*20-19(21,22)15-11-13-18(14-12-15)24(23,16-7-3-1-4-8-16)17-9-5-2-6-10-17;;/h2*11-23H,1-10H3;2*1-14,23H;;/q;;2*-1;;/b2*34-24+,35-25+
• InChIKey: KVPOHQFNVYYYCQ-WNFRFSHCSA-N
• XLogP: 27.16
• TPSA: 122.82 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 22
• Heavy Atoms: 122
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2032.72
LogP ≤ 5	27.16
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of bis([diphenyl-[4-(trifluoromethyl)phenyl]silyl]azanide);bis(N-[2,6-di(propan-2-yl)phenyl]-1-[6-[N-[2,6-di(propan-2-yl)phenyl]-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine);bis(iridium)?

The IUPAC name of bis([diphenyl-[4-(trifluoromethyl)phenyl]silyl]azanide);bis(N-[2,6-di(propan-2-yl)phenyl]-1-[6-[N-[2,6-di(propan-2-yl)phenyl]-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine);bis(iridium) (CID 139121912) is bis([diphenyl-[4-(trifluoromethyl)phenyl]silyl]azanide);bis(N-[2,6-di(propan-2-yl)phenyl]-1-[6-[N-[2,6-di(propan-2-yl)phenyl]-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine);bis(iridium).

What is the SMILES notation for bis([diphenyl-[4-(trifluoromethyl)phenyl]silyl]azanide);bis(N-[2,6-di(propan-2-yl)phenyl]-1-[6-[N-[2,6-di(propan-2-yl)phenyl]-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine);bis(iridium)?

The canonical SMILES for bis([diphenyl-[4-(trifluoromethyl)phenyl]silyl]azanide);bis(N-[2,6-di(propan-2-yl)phenyl]-1-[6-[N-[2,6-di(propan-2-yl)phenyl]-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine);bis(iridium) is C/C(=N\c1c(C(C)C)cccc1C(C)C)c1cccc(/C(C)=N/c2c(C(C)C)cccc2C(C)C)n1.C/C(=N\c1c(C(C)C)cccc1C(C)C)c1cccc(/C(C)=N/c2c(C(C)C)cccc2C(C)C)n1.[Ir].[Ir].[NH-][Si](c1ccccc1)(c1ccccc1)c1ccc(C(F)(F)F)cc1.[NH-][Si](c1ccccc1)(c1ccccc1)c1ccc(C(F)(F)F)cc1.

What is the InChIKey of bis([diphenyl-[4-(trifluoromethyl)phenyl]silyl]azanide);bis(N-[2,6-di(propan-2-yl)phenyl]-1-[6-[N-[2,6-di(propan-2-yl)phenyl]-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine);bis(iridium)?

The InChIKey is KVPOHQFNVYYYCQ-WNFRFSHCSA-N. The full InChI is InChI=1S/2C33H43N3.2C19H15F3NSi.2Ir/c2*1-20(2)26-14-11-15-27(21(3)4)32(26)34-24(9)30-18-13-19-31(36-30)25(10)35-33-28(22(5)6)16-12-17-29(33)23(7)8;2*20-19(21,22)15-11-13-18(14-12-15)24(23,16-7-3-1-4-8-16)17-9-5-2-6-10-17;;/h2*11-23H,1-10H3;2*1-14,23H;;/q;;2*-1;;/b2*34-24+,35-25+;;;;.

What are the key properties of bis([diphenyl-[4-(trifluoromethyl)phenyl]silyl]azanide);bis(N-[2,6-di(propan-2-yl)phenyl]-1-[6-[N-[2,6-di(propan-2-yl)phenyl]-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine);bis(iridium)?

bis([diphenyl-[4-(trifluoromethyl)phenyl]silyl]azanide);bis(N-[2,6-di(propan-2-yl)phenyl]-1-[6-[N-[2,6-di(propan-2-yl)phenyl]-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine);bis(iridium) has a molecular weight of 2032.72 g/mol, XLogP of 27.16, 22 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for bis([diphenyl-[4-(trifluoromethyl)phenyl]silyl]azanide);bis(N-[2,6-di(propan-2-yl)phenyl]-1-[6-[N-[2,6-di(propan-2-yl)phenyl]-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine);bis(iridium) is sourced from PubChem (CID 139121912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).